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CAS 54711-21-6

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5-Amino-4-cyano-1H-pyrazole-3-acetonitrile

Description:
5-Amino-4-cyano-1H-pyrazole-3-acetonitrile is an organic compound characterized by its pyrazole ring structure, which is a five-membered heterocyclic compound containing two nitrogen atoms. This substance features an amino group (-NH2) and a cyano group (-CN) attached to the pyrazole ring, contributing to its reactivity and potential applications in various chemical syntheses. The presence of the acetonitrile group enhances its solubility in polar solvents, making it useful in organic reactions. The compound is typically a solid at room temperature and may exhibit moderate stability under standard conditions. Its unique functional groups suggest potential applications in pharmaceuticals, agrochemicals, and as intermediates in organic synthesis. However, handling should be done with care due to the presence of the cyano group, which can be toxic. As with many nitrogen-containing heterocycles, it may also exhibit interesting biological activities, warranting further investigation in medicinal chemistry.
Formula:C6H5N5
InChI:InChI=1S/C6H5N5/c7-2-1-5-4(3-8)6(9)11-10-5/h1H2,(H3,9,10,11)
InChI key:InChIKey=GSXISOIYTHIBLC-UHFFFAOYSA-N
SMILES:C(C#N)C=1C(C#N)=C(N)NN1
Synonyms:
  • 1H-Pyrazole-3-acetonitrile, 5-amino-4-cyano-
  • 3-Amino-4-cyano-5-cyanomethylpyrazole
  • 3-Cyanomethyl-4-cyano-5-amino-1H-pyrazole
  • 3-Cyanomethyl-4-cyano-5-aminopyrazole
  • 3-amino-5-(cyanomethyl)-1H-pyrazole-4-carbonitrile
  • 4-Pyrazolecarbonitrile, 5-amino-3-cyanomethyl-
  • 5-Amino-3-cyanomethyl-1H-pyrazole-4-carbonitrile
  • 5-Amino-4-cyano-3-(cyanomethyl)pyrazole
  • Ai3-61179
  • Nsc 22478
  • See more synonyms
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